[5-[(2-fluoranyl-3-tetradecanoyloxy-tetradecanoyl)amino]-2-(hydroxymethyl)-3-oxidanyl-6-prop-2-enoxy-oxan-4-yl] 3-phenylmethoxytetradecanoate

Systemtic Name: [5-[(2-fluoranyl-3-tetradecanoyloxy-tetradecanoyl)amino]-2-(hydroxymethyl)-3-oxidanyl-6-prop-2-enoxy-oxan-4-yl] 3-phenylmethoxytetradecanoate Openeye Name: [2-allyloxy-3-[(2-fluoro-3-tetradecanoyloxy-tetradecanoyl)amino]-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl] 3-benzyloxytetradecanoate CAS Name: 3-phenylmethoxytetradecanoic acid [5-[[2-fluoro-1-oxo-3-(1-oxotetradecoxy)tetradecyl]amino]-3-hydroxy-2-(hydroxymethyl)-6-prop-2-enoxy-4-oxanyl] ester IUPAC Name: [5-[(2-fluoro-3-tetradecanoyloxytetradecanoyl)amino]-3-hydroxy-2-(hydroxymethyl)-6-prop-2-enoxyoxan-4-yl] 3-phenylmethoxytetradecanoate Traditional Name: 3-benzoxymyristic acid [2-allyloxy-3-[(2-fluoro-3-tetradecanoyloxy-tetradecanoyl)amino]-5-hydroxy-6-methylol-tetrahydropyran-4-yl] ester Formula: C58H100FNO10 MolecularWeight: 990.413703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)C(C(=O)NC1C(C(C(OC1OCC=C)CO)O)OC(=O)CC(CCCCCCCCCCC)OCC2=CC=CC=C2)F

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)C(C(=O)NC1C(C(C(OC1OCC=C)CO)O)OC(=O)CC(CCCCCCCCCCC)OCC2=CC=CC=C2)F

InChI

InChI=1S/C58H100FNO10/c1-5-9-12-15-18-21-22-25-28-31-37-42-51(62)68-49(41-36-30-27-24-20-17-14-11-7-3)53(59)57(65)60-54-56(55(64)50(45-61)69-58(54)66-43-8-4)70-52(63)44-48(67-46-47-38-33-32-34-39-47)40-35-29-26-23-19-16-13-10-6-2/h8,32-34,38-39,48-50,53-56,58,61,64H,4-7,9-31,35-37,40-46H2,1-3H3,(H,60,65)